Home Sulfos 4-Chloro-N-(2-chloro-4-nitrophenyl)-3-(trifluoromethyl)benzenesulfonamide

4-Chloro-N-(2-chloro-4-nitrophenyl)-3-(trifluoromethyl)benzenesulfonamide

CAS No.:
106917-52-6
Catalog Number:
AG0039Y3
Molecular Formula:
C13H7Cl2F3N2O4S
Molecular Weight:
415.1719
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Product Description
Catalog Number:
AG0039Y3
Chemical Name:
4-Chloro-N-(2-chloro-4-nitrophenyl)-3-(trifluoromethyl)benzenesulfonamide
CAS Number:
106917-52-6
Molecular Formula:
C13H7Cl2F3N2O4S
Molecular Weight:
415.1719
MDL Number:
MFCD00274593
IUPAC Name:
4-chloro-N-(2-chloro-4-nitrophenyl)-3-(trifluoromethyl)benzenesulfonamide
InChI:
InChI=1S/C13H7Cl2F3N2O4S/c14-10-3-2-8(6-9(10)13(16,17)18)25(23,24)19-12-4-1-7(20(21)22)5-11(12)15/h1-6,19H
InChI Key:
GNVDAZSPJWCIQZ-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1NS(=O)(=O)c1ccc(c(c1)C(F)(F)F)Cl)[N+](=O)[O-]
UNII:
LKO7028G4U
Properties
Complexity:
594  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
413.946g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
415.164g/mol
Monoisotopic Mass:
413.946g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Literature
Title Journal
Antifungal activities of N-arylbenzenesulfonamides against phytopathogens and control efficacy on wheat leaf rust and cabbage club root diseases. Bioscience, biotechnology, and biochemistry 20021201
[Clean-up procedure with ion-exchange mini column in the analysis of flusulfamide in agricultural products by HPLC]. Shokuhin eiseigaku zasshi. Journal of the Food Hygienic Society of Japan 20011201
Properties